1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one

C14H16N4OS — CID 154569202

IUPAC1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one
SMILESO=C1CC(Cn2ccnc2-c2cnsc2)CN1C1CC1
InChIInChI=1S/C14H16N4OS/c19-13-5-10(8-18(13)12-1-2-12)7-17-4-3-15-14(17)11-6-16-20-9-11/h3-4,6,9-10,12H,1-2,5,7-8H2
InChIKeyJZTWVCPVIGKVCJ-UHFFFAOYSA-N
MW288.38 g/mol
LogP2.02
Rot. Bonds4

About 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one

1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one (PubChem CID 154569202) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one
PubChem CID154569202
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC Name1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one
SMILESO=C1CC(Cn2ccnc2-c2cnsc2)CN1C1CC1
InChIInChI=1S/C14H16N4OS/c19-13-5-10(8-18(13)12-1-2-12)7-17-4-3-15-14(17)11-6-16-20-9-11/h3-4,6,9-10,12H,1-2,5,7-8H2
InChIKeyJZTWVCPVIGKVCJ-UHFFFAOYSA-N
XLogP2.02
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropyl-4-[[2-(2,6-difluoro-3-methylphenyl)imidazol-1-yl]methyl]pyrrolidin-2-one
CID 155491539
4-[(2-cyclohexylimidazol-1-yl)methyl]-1-cyclopropylpyrrolidin-2-one
CID 146038204
(4S)-1-cyclopropyl-4-(hydroxymethyl)pyrrolidin-2-one
CID 42259346
1-cyclopentyl-4-[(5-cyclopropyl-4-phenylimidazol-1-yl)methyl]pyrrolidin-2-one
CID 50955366
1-methyl-4-[[2-[2-(3-methylphenyl)pyrimidin-5-yl]imidazol-1-yl]methyl]pyrrolidin-2-one
CID 146041584
4-[1-[2-(furan-2-yl)ethyl]imidazol-2-yl]-1,2-thiazole
CID 155911948
4-[1-(cyclobutylmethyl)imidazol-2-yl]aniline
CID 65458282
4-(hydroxymethyl)-1-(4-propan-2-ylcyclohexyl)pyrrolidin-2-one
CID 168661983
4-[1-(oxan-4-ylmethyl)imidazol-2-yl]pyridine
CID 155912859
1-cyclopropyl-4-[[5-(5-fluoro-2-methylphenyl)-4-phenylimidazol-1-yl]methyl]pyrrolidin-2-one
CID 50984509
(4S)-1-ethyl-4-[[2-[3-(pyrazol-1-ylmethyl)phenyl]imidazol-1-yl]methyl]pyrrolidin-2-one
CID 95553395
N-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-3-methylpyridine-4-carboxamide
CID 125160120

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one?
The IUPAC name of 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one (CID 154569202) is 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one.
What is the SMILES notation for 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one?
The canonical SMILES for 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one is O=C1CC(Cn2ccnc2-c2cnsc2)CN1C1CC1.
What is the InChIKey of 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one?
The InChIKey is JZTWVCPVIGKVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c19-13-5-10(8-18(13)12-1-2-12)7-17-4-3-15-14(17)11-6-16-20-9-11/h3-4,6,9-10,12H,1-2,5,7-8H2.
What are the key properties of 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one?
1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one has a molecular weight of 288.38 g/mol, XLogP of 2.02, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-[[2-(1,2-thiazol-4-yl)imidazol-1-yl]methyl]pyrrolidin-2-one is sourced from PubChem (CID 154569202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).